methyl 2-[[(2Z)-2-[(5-bromanyl-2-methoxy-phenyl)methylidene]-3-oxidanylidene-1-benzofuran-6-yl]oxy]propanoate

Systemtic Name: methyl 2-[[(2Z)-2-[(5-bromanyl-2-methoxy-phenyl)methylidene]-3-oxidanylidene-1-benzofuran-6-yl]oxy]propanoate Openeye Name: methyl 2-[(2Z)-2-[(5-bromo-2-methoxy-phenyl)methylene]-3-oxo-benzofuran-6-yl]oxypropanoate CAS Name: 2-[[(2Z)-2-[(5-bromo-2-methoxyphenyl)methylidene]-3-oxo-6-benzofuranyl]oxy]propanoic acid methyl ester IUPAC Name: methyl 2-[[(2Z)-2-[(5-bromo-2-methoxyphenyl)methylidene]-3-oxo-1-benzofuran-6-yl]oxy]propanoate Traditional Name: 2-[(2Z)-2-(5-bromo-2-methoxy-benzylidene)-3-keto-coumaran-6-yl]oxypropionic acid methyl ester Formula: C20H17BrO6 MolecularWeight: 433.24938

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)OC)OC1=CC2=C(C=C1)C(=O)C(=CC3=C(C=CC(=C3)Br)OC)O2

Isomeric SMILES

CC(C(=O)OC)OC1=CC2=C(C=C1)C(=O)/C(=C/C3=C(C=CC(=C3)Br)OC)/O2

InChI

InChI=1S/C20H17BrO6/c1-11(20(23)25-3)26-14-5-6-15-17(10-14)27-18(19(15)22)9-12-8-13(21)4-7-16(12)24-2/h4-11H,1-3H3/b18-9-